SCHEMBL11247291

SCHEMBL11247291

[CH2]Sc1nnnn1CC#N

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11247305 0.81 KMT2A (0.62) LMNAKMT2AALDH1A1CYP1A2
SCHEMBL11116878 0.78 ALDH1A1 (0.42) LMNAKMT2AALDH1A1
SCHEMBL9479526 0.74
SCHEMBL10475166 0.71 LMNA (0.48) LMNAKMT2AALDH1A1CYP1A2
SCHEMBL11689701 0.71 KMT2A (0.53) LMNAKMT2AALDH1A1CYP1A2
SCHEMBL13638133 0.69
SCHEMBL11076123 0.69
SCHEMBL10792969 0.69 LMNA (0.38) LMNAKMT2AALDH1A1CYP1A2
SCHEMBL3742866 0.67 LMNA (0.48) LMNAKMT2AALDH1A1
SCHEMBL10189375 0.65 GHSR (0.33) LMNAKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0048168-A2 7-Acylamino cephalosporin compounds, their preparation and pharmaceutical formulations containing them ELI LILLY AND COMPANY (US) 1982-03-24 EP disclosed